%chk=000253600.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000253600

0 1
O -0.054203 3.748736 0.248035
O 4.295930 -3.980974 0.311356
O -3.924562 -4.257947 -0.153598
N 1.139223 1.705050 0.058938
N -1.138880 1.648257 0.028551
C 0.724848 0.332518 -0.020322
C -0.654098 0.298537 -0.040483
C -0.022431 2.544118 0.119055
C 1.656081 -0.792474 0.014691
C -1.529389 -0.871375 -0.040690
C 2.487962 2.202610 0.029372
C -2.510362 2.077336 -0.017676
C 1.742145 -1.677573 -1.068085
C -2.269725 -1.191576 1.107038
C 2.458126 -1.000426 1.158093
C -1.617621 -1.689913 -1.185130
C 3.472939 1.548782 -0.730464
C -3.450176 1.383216 -0.798457
C 2.799311 3.364805 0.759930
C -2.890656 3.215531 0.718444
C 2.612671 -2.770725 -1.029048
C -3.094367 -2.319179 1.130541
C 3.328884 -2.078307 1.218159
C -2.430589 -2.814834 -1.183866
C 3.395450 -2.960047 0.116306
C -3.164138 -3.120182 -0.016309
C 4.777065 2.048700 -0.728482
C -4.777401 1.818167 -0.812848
C 4.106583 3.851613 0.740378
C -4.219887 3.637291 0.682703
C 5.099171 3.194320 0.005285
C -5.167358 2.939005 -0.073946
C 4.447310 -4.964120 -0.741474
C -4.724082 -4.681131 0.977850
H 1.126426 -1.513465 -1.953508
H -2.201905 -0.553124 1.989958
H 2.389584 -0.304391 1.996415
H -1.045633 -1.432011 -2.077539
H 3.229635 0.665389 -1.318717
H -3.154972 0.519635 -1.392142
H 2.020968 3.893397 1.316205
H -2.148151 3.776901 1.291359
H 2.666138 -3.449234 -1.873238
H -3.660823 -2.555191 2.025040
H 3.957017 -2.260396 2.087732
H -2.515422 -3.462941 -2.053111
H 5.546183 1.540755 -1.309628
H -5.510772 1.279195 -1.412022
H 4.351917 4.752540 1.302586
H -4.518052 4.519707 1.248700
H 6.117087 3.577494 -0.000014
H -6.202528 3.272080 -0.092700
H 4.818968 -4.489616 -1.653956
H 3.503551 -5.491213 -0.908164
H 5.202325 -5.636159 -0.312127
H -5.468223 -3.918312 1.223989
H -4.080991 -4.916802 1.830599
H -5.204501 -5.587151 0.585231


%chk=000253600-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000253600

0 1
O -0.064885 3.702950 0.550333
O 4.550857 -3.954370 0.406337
O -4.118651 -4.297918 -0.138651
N 1.132625 1.651827 0.134876
N -1.114746 1.577738 0.111590
C 0.751374 0.297982 -0.134045
C -0.639097 0.254333 -0.156112
C -0.020929 2.465131 0.314460
C 1.725863 -0.811874 -0.057036
C -1.544726 -0.916893 -0.142558
C 2.455626 2.204775 0.044897
C -2.474758 2.034174 0.047476
C 1.796525 -1.835372 -1.033213
C -2.386039 -1.153234 0.976029
C 2.632261 -0.877214 1.043660
C -1.619107 -1.824583 -1.234665
C 3.353320 1.745393 -0.951265
C -3.349798 1.540018 -0.951887
C 2.853919 3.228857 0.939456
C -2.934816 3.000668 0.976166
C 2.715099 -2.903254 -0.921958
C -3.255677 -2.262082 1.023866
C 3.552556 -1.927558 1.166921
C -2.478215 -2.936309 -1.203413
C 3.596148 -2.951331 0.185220
C -3.297959 -3.163234 -0.070184
C 4.649372 2.295491 -1.035818
C -4.683224 1.997522 -1.005995
C 4.148490 3.781492 0.836103
C -4.266686 3.461293 0.903667
C 5.054579 3.315645 -0.144276
C -5.149512 2.959625 -0.080397
C 4.629071 -5.042183 -0.571493
C -4.992509 -4.573844 1.005000
H 1.141431 -1.791012 -1.907917
H -2.354747 -0.462284 1.825480
H 2.603913 -0.097018 1.811404
H -1.021429 -1.636888 -2.132272
H 3.038571 0.967550 -1.652642
H -2.989490 0.809423 -1.681298
H 2.147731 3.600340 1.685575
H -2.247518 3.400866 1.725207
H 2.735719 -3.674106 -1.697928
H -3.884648 -2.412143 1.906156
H 4.244399 -1.981952 2.012642
H -2.538930 -3.634092 -2.043838
H 5.338765 1.931859 -1.805794
H -5.353661 1.608483 -1.780296
H 4.448068 4.577658 1.526463
H -4.613326 4.214213 1.620091
H 6.059813 3.744915 -0.216556
H -6.183389 3.318305 -0.130193
H 4.905108 -4.662823 -1.574717
H 3.672208 -5.596156 -0.634278
H 5.419873 -5.708558 -0.197264
H -5.713832 -3.749820 1.168760
H -4.405215 -4.742987 1.928322
H -5.534163 -5.492541 0.736598


